Ensemble refinement model

PDB 5TKS|dpdb_21b4a69d

Ensemble refinement model

FACTOR XIA IN COMPLEX WITH THE INHIBITOR ((15S)-18-CHLORO- 15-(((2E)-3-(5-CHLORO-2-(1H-TETRAZOL-1-YL)PHENYL)-2- PROPENOYL)AMINO)-17,19-DIAZATRICYCLO[14.2.1.0~2,7~]NONADECA-1(18),2,4,6,16(19)-PENTAEN-5-YL)CARBAMATE

Program
PHENIX phenix.ensemble_refinement
Model type
Ensemble
Purpose
Refinement
Atoms
144,006
Residues
238
Protein chains
1
Alternate-location fraction
0%
Ligands
7DL, EDO, SO4

Evaluations

R-work
0.145
R-free
0.165
Clashscore
—

Macromolecules

The same in every model of this entry.

Entity 1
MoleculeChainsLengthOrganismUniProtDetails
Coagulation factor XI244
  • MutationsN113G T115G

Data

L0 Raw
L1 Processed
L2 Models
L3 Evaluations